Cas no 913569-24-1 (1-(2-Amino-4-(trifluoromethoxy)phenyl)ethanone)

1-(2-Amino-4-(trifluoromethoxy)phenyl)ethanone is a fluorinated aromatic ketone derivative featuring both an amino group and a trifluoromethoxy substituent on the phenyl ring. This compound is of interest in pharmaceutical and agrochemical research due to its versatile reactivity, particularly as a building block for synthesizing more complex molecules. The presence of the electron-withdrawing trifluoromethoxy group enhances its stability and influences its electronic properties, making it valuable in the development of bioactive compounds. The amino group provides a reactive site for further functionalization, enabling applications in medicinal chemistry and material science. Its well-defined structure and purity make it suitable for precise synthetic applications.
1-(2-Amino-4-(trifluoromethoxy)phenyl)ethanone structure
913569-24-1 structure
Product Name:1-(2-Amino-4-(trifluoromethoxy)phenyl)ethanone
CAS No:913569-24-1
MF:C9H8F3NO2
MW:219.160532951355
CID:996322
PubChem ID:46835494
Update Time:2025-10-29

1-(2-Amino-4-(trifluoromethoxy)phenyl)ethanone Chemical and Physical Properties

Names and Identifiers

    • 1-(2-Amino-4-(trifluoromethoxy)phenyl)ethanone
    • 1-[2-Amino-4-(trifluoromethoxy)phenyl]ethanone
    • Ethanone,1-[2-amino-4-(trifluoromethoxy)phenyl]-
    • 913569-24-1
    • 1-[2-Amino-4-(trifluoromethoxy)phenyl]ethan-1-one
    • 1-(2-amino-4-(trifluoromethoxy)phenyl)ethan-1-one
    • 1-[2-amino-4-(trifluoromethoxy)phenyl]-Ethanone
    • SB79004
    • DTXSID20676428
    • Q-101062
    • AKOS015841025
    • Inchi: 1S/C9H8F3NO2/c1-5(14)7-3-2-6(4-8(7)13)15-9(10,11)12/h2-4H,13H2,1H3
    • InChI Key: UFFMJWAFMDSQPN-UHFFFAOYSA-N
    • SMILES: FC(OC1C=CC(C(C)=O)=C(C=1)N)(F)F

Computed Properties

  • Exact Mass: 219.051
  • Monoisotopic Mass: 219.051
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 3
  • Complexity: 242
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 3
  • Topological Polar Surface Area: 52.3A^2

1-(2-Amino-4-(trifluoromethoxy)phenyl)ethanone Pricemore >>

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Additional information on 1-(2-Amino-4-(trifluoromethoxy)phenyl)ethanone

Comprehensive Overview of 1-(2-Amino-4-(trifluoromethoxy)phenyl)ethanone (CAS No. 913569-24-1)

1-(2-Amino-4-(trifluoromethoxy)phenyl)ethanone, with the CAS number 913569-24-1, is a specialized organic compound that has garnered significant attention in pharmaceutical and agrochemical research. This compound features a unique molecular structure, combining an amino group and a trifluoromethoxy moiety, which enhances its reactivity and potential applications. Researchers are particularly interested in its role as a key intermediate in the synthesis of bioactive molecules, owing to its versatile chemical properties.

The growing demand for trifluoromethoxy-containing compounds in drug discovery has placed 1-(2-Amino-4-(trifluoromethoxy)phenyl)ethanone at the forefront of modern medicinal chemistry. Its electron-withdrawing trifluoromethoxy group improves metabolic stability and bioavailability, making it a valuable building block for targeted therapies. Recent studies highlight its potential in developing CNS-active drugs and antimicrobial agents, aligning with the current focus on combating antibiotic resistance and neurological disorders.

In the agrochemical sector, CAS 913569-24-1 is explored for its utility in designing novel pesticides and herbicides. The trifluoromethoxy group contributes to enhanced pesticidal activity, addressing the need for eco-friendly crop protection solutions. This aligns with the global push toward sustainable agriculture, a topic frequently searched by stakeholders in the agrochemical industry.

From a synthetic perspective, 1-(2-Amino-4-(trifluoromethoxy)phenyl)ethanone is synthesized via multi-step organic reactions, often involving Friedel-Crafts acylation and nitration-reduction sequences. Its purity and yield are critical for downstream applications, driving innovations in green chemistry and catalytic processes. Researchers are also investigating its structure-activity relationships (SAR) to optimize its performance in various applications.

The compound’s physicochemical properties, such as solubility and thermal stability, are well-documented, making it a reliable choice for high-throughput screening and combinatorial chemistry. Its molecular weight and logP value further support its suitability for drug-like molecules, a hot topic in computational chemistry and AI-driven drug design.

In summary, 1-(2-Amino-4-(trifluoromethoxy)phenyl)ethanone (CAS 913569-24-1) is a multifaceted compound with broad applications in pharmaceuticals, agrochemicals, and material science. Its unique structural features and functional groups make it a subject of ongoing research, particularly in areas like precision medicine and sustainable chemistry. As the scientific community continues to explore its potential, this compound is poised to play a pivotal role in addressing some of the most pressing challenges in modern science.

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